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Keywords = bismuth halide perovskites

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12 pages, 1742 KiB  
Article
Simulation of Lead-Free Perovskite Solar Cells with Improved Performance
by Saood Ali, Praveen Kumar, Khursheed Ahmad and Rais Ahmad Khan
Crystals 2025, 15(2), 171; https://doi.org/10.3390/cryst15020171 - 10 Feb 2025
Cited by 5 | Viewed by 1107
Abstract
At present, lead halide PVSKSCs are promising photovoltaic cells but have some limitations, including their low stability in ambient conditions and the toxicity of lead. Thus, it will be of great significance to explore lead-free perovskite materials as an alternative absorber layer. In [...] Read more.
At present, lead halide PVSKSCs are promising photovoltaic cells but have some limitations, including their low stability in ambient conditions and the toxicity of lead. Thus, it will be of great significance to explore lead-free perovskite materials as an alternative absorber layer. In recent years, the numerical simulation of perovskite solar cells (PVSKSCs) via the solar cell capacitance simulation (SCAPS) method has attracted the attention of the scientific community. In this work, we adopted SCAPS for the theoretical study of lead (Pb)-free PVSKSCs. A cesium bismuth iodide (CsBi3I10; CBI) perovskite-like material was used as an absorber layer. The thickness of the CBI layer was optimized. In addition, different electron transport layers (ETLs), such as titanium dioxide (TiO2), tin oxide (SnO2), zinc oxide (ZnO), and zinc selenide (ZnSe), and different hole transport layers, such as spiro-OMeTAD (2,2,7,7-tetrakis(N,N-di(4-methoxyphenylamine)-9,9′-spirobifluorene), poly(3-hexylthiophene-2,5-diyl) (P3HT), poly[bis(4-phenyl)(2,4,6-trimethylphenyl)amine (PTAA), and copper oxide (Cu2O), were explored for the simulation of CBI-based PVSKSCs. A device structure of FTO/ETL/CBI/HTL/Au was adopted for simulation studies. The simulation studies showed the improved photovoltaic performance of CBI-based PVSKSCs using spiro-OMeTAD and TiO2 as the HTL and ETL, respectively. An acceptable PCE of 11.98% with a photocurrent density (Jsc) of 17.360258 mA/cm2, a fill factor (FF) of 67.10%, and an open-circuit voltage (Voc) of 1.0282 V were achieved under the optimized conditions. It is expected that the present study will be beneficial for researchers working towards the development of CBI-based PVSKSCs. Full article
(This article belongs to the Section Materials for Energy Applications)
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12 pages, 2584 KiB  
Article
Bandgap Engineering via Doping Strategies for Narrowing the Bandgap below 1.2 eV in Sn/Pb Binary Perovskites: Unveiling the Role of Bi3+ Incorporation on Different A-Site Compositions
by Jeong-Yeon Lee, Seojun Lee, Jun Ryu and Dong-Won Kang
Nanomaterials 2024, 14(19), 1554; https://doi.org/10.3390/nano14191554 - 26 Sep 2024
Cited by 4 | Viewed by 1856
Abstract
The integration of perovskite materials in solar cells has garnered significant attention due to their exceptional photovoltaic properties. However, achieving a bandgap energy below 1.2 eV remains challenging, particularly for applications requiring infrared absorption, such as sub-cells in tandem solar cells and single-junction [...] Read more.
The integration of perovskite materials in solar cells has garnered significant attention due to their exceptional photovoltaic properties. However, achieving a bandgap energy below 1.2 eV remains challenging, particularly for applications requiring infrared absorption, such as sub-cells in tandem solar cells and single-junction perovskite solar cells. In this study, we employed a doping strategy to engineer the bandgap and observed that the doping effects varied depending on the A-site cation. Specifically, we investigated the impact of bismuth (Bi3+) incorporation into perovskites with different A-site cations, such as cesium (Cs) and methylammonium (MA). Remarkably, Bi3+ doping in MA-based tin-lead perovskites enabled the fabrication of ultra-narrow bandgap films (~1 eV). Comprehensive characterization, including structural, optical, and electronic analyses, was conducted to elucidate the effects of Bi doping. Notably, 8% Bi-doped Sn-Pb perovskites demonstrated infrared absorption extending up to 1360 nm, an unprecedented range for ABX3-type single halide perovskites. This work provides valuable insights into further narrowing the bandgap of halide perovskite materials, which is essential for their effective use in multi-junction tandem solar cell architectures. Full article
(This article belongs to the Special Issue Nanostructured Materials for Electric Applications)
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22 pages, 6490 KiB  
Article
Enhancing the Photocatalytic Activity of Halide Perovskite Cesium Bismuth Bromide/Hydrogen Titanate Heterostructures for Benzyl Alcohol Oxidation
by Huzaikha Awang, Abdo Hezam, Tim Peppel and Jennifer Strunk
Nanomaterials 2024, 14(9), 752; https://doi.org/10.3390/nano14090752 - 25 Apr 2024
Cited by 4 | Viewed by 2072
Abstract
Halide perovskite Cs3Bi2Br9 (CBB) has excellent potential in photocatalysis due to its promising light-harvesting properties. However, its photocatalytic performance might be limited due to the unfavorable charge carrier migration and water-induced properties, which limit the stability and photocatalytic [...] Read more.
Halide perovskite Cs3Bi2Br9 (CBB) has excellent potential in photocatalysis due to its promising light-harvesting properties. However, its photocatalytic performance might be limited due to the unfavorable charge carrier migration and water-induced properties, which limit the stability and photocatalytic performance. Therefore, we address this constraint in this work by synthesizing a stable halide perovskite heterojunction by introducing hydrogen titanate nanosheets (H2Ti3O7-NS, HTiO-NS). Optimizing the weight % (wt%) of CBB enables synthesizing the optimal CBB/HTiO-NS, CBHTNS heterostructure. The detailed morphology and structure characterization proved that the cubic shape of CBB is anchored on the HTiO-NS surface. The 30 wt% CBB/HTiO-NS-30 (CBHTNS-30) heterojunction showed the highest BnOH photooxidation performance with 98% conversion and 75% benzoic acid (BzA) selectivity at 2 h under blue light irradiation. Detailed optical and photoelectrochemical characterization showed that the incorporating CBB and HTiO-NS widened the range of the visible-light response and improved the ability to separate the photo-induced charge carriers. The presence of HTiO-NS has increased the oxidative properties, possibly by charge separation in the heterojunction, which facilitated the generation of superoxide and hydroxyl radicals. A possible reaction pathway for the photocatalytic oxidation of BnOH to BzH and BzA was also suggested. Furthermore, through scavenger experiments, we found that the photogenerated h+, e and •O2 play an essential role in the BnOH photooxidation, while the •OH have a minor effect on the reaction. This work may provide a strategy for using HTiO-NS-based photocatalyst to enhance the charge carrier migration and photocatalytic performance of CBB. Full article
(This article belongs to the Special Issue Perovskite Nanostructures: Synthesis, Properties and Applications)
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29 pages, 45407 KiB  
Review
Lead-Free Halide Perovskite Nanocrystals for Light-Emitting Diodes
by Do-Young Kim, Jae-Geun Jung, Ye-Ji Lee and Min-Ho Park
Materials 2023, 16(18), 6317; https://doi.org/10.3390/ma16186317 - 20 Sep 2023
Cited by 6 | Viewed by 3945
Abstract
Lead-based halide perovskite nanocrystals (PeNCs) have demonstrated remarkable potential for use in light-emitting diodes (LEDs). This is because of their high photoluminescence quantum yield, defect tolerance, tunable emission wavelength, color purity, and high device efficiency. However, the environmental toxicity of Pb has impeded [...] Read more.
Lead-based halide perovskite nanocrystals (PeNCs) have demonstrated remarkable potential for use in light-emitting diodes (LEDs). This is because of their high photoluminescence quantum yield, defect tolerance, tunable emission wavelength, color purity, and high device efficiency. However, the environmental toxicity of Pb has impeded their commercial viability owing to the restriction of hazardous substances directive. Therefore, Pb-free PeNCs have emerged as a promising solution for the development of eco-friendly LEDs. This review article presents a detailed analysis of the various compositions of Pb-free PeNCs, including tin-, bismuth-, antimony-, and copper-based perovskites and double perovskites, focusing on their stability, optoelectronic properties, and device performance in LEDs. Furthermore, we address the challenges encountered in using Pb-free PeNC-LEDs and discuss the prospects and potential of these Pb-free PeNCs as sustainable alternatives to lead-based PeLEDs. In this review, we aim to shed light on the current state of Pb-free PeNC LEDs and highlight their significance in driving the development of eco-friendly LED technologies. Full article
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14 pages, 5274 KiB  
Article
Efficiency Enhancement Strategies for Stable Bismuth-Based Perovskite and Its Bioimaging Applications
by Liangyan Xiao, Linwei Huang, Weihaojia Su, Tianjun Wang, Haiying Liu, Zhongchao Wei and Haihua Fan
Int. J. Mol. Sci. 2023, 24(5), 4711; https://doi.org/10.3390/ijms24054711 - 1 Mar 2023
Cited by 9 | Viewed by 3130
Abstract
Lead-free perovskite is one of the ideal solutions for the toxicity and instability of lead halide perovskite quantum dots. As the most ideal lead-free perovskite at present, bismuth-based perovskite quantum dots still have the problem of a low photoluminescence quantum yield, and its [...] Read more.
Lead-free perovskite is one of the ideal solutions for the toxicity and instability of lead halide perovskite quantum dots. As the most ideal lead-free perovskite at present, bismuth-based perovskite quantum dots still have the problem of a low photoluminescence quantum yield, and its biocompatibility also needs to be explored. In this paper, Ce3+ ions were successfully introduced into the Cs3Bi2Cl9 lattice using a modified antisolvent method. The photoluminescence quantum yield of Cs3Bi2Cl9:Ce is up to 22.12%, which is 71% higher than that of undoped Cs3Bi2Cl9. The two quantum dots show high water-soluble stability and good biocompatibility. Under the excitation of a 750 nm femtosecond laser, high-intensity up-conversion fluorescence images of human liver hepatocellular carcinoma cells cultured with the quantum dots were obtained, and the fluorescence of the two quantum dots was observed in the image of the nucleus. The fluorescence intensity of cells cultured with Cs3Bi2Cl9:Ce was 3.20 times of that of the control group and 4.54 times of the control group for the fluorescence intensity of the nucleus, respectively. This paper provides a new strategy to develop the biocompatibility and water stability of perovskite and expands the application of perovskite in the field. Full article
(This article belongs to the Special Issue Research Progress of Bioimaging Materials)
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19 pages, 3756 KiB  
Review
Bismuth-Based Halide Perovskites for Photocatalytic H2 Evolution Application
by Costanza Tedesco and Lorenzo Malavasi
Molecules 2023, 28(1), 339; https://doi.org/10.3390/molecules28010339 - 1 Jan 2023
Cited by 17 | Viewed by 4251
Abstract
Metal halide perovskites (MHPs), in particular lead-based perovskites, have earned recognized fame in several fields for their outstanding optoelectronic properties, including direct generation of free charge carriers, optimal ambipolar charge carrier transport properties, high absorption coefficient, point-defect tolerance, and compositional versatility. Nowadays, this [...] Read more.
Metal halide perovskites (MHPs), in particular lead-based perovskites, have earned recognized fame in several fields for their outstanding optoelectronic properties, including direct generation of free charge carriers, optimal ambipolar charge carrier transport properties, high absorption coefficient, point-defect tolerance, and compositional versatility. Nowadays, this class of materials represents a real and promising alternative to silicon for photovoltaic technologies. This worthy success led to a growing interest in the exploration of MHPs in other hot research fields, such as solar-driven photocatalytic water splitting towards hydrogen production. Nevertheless, many of these perovskites show air and moisture instability problems that considerably hinder their practical application for photocatalytic water splitting. Moreover, if chemical instability is a problem that can be in part mitigated by the optimization of the chemical composition and crystal structure, the presence of lead represents a real problem for the practical application of MHPs in commercial devices due to environmental and healthcare issues. To successfully overcome these problems, lead-free metal halide perovskites (LFMHPs) have gained increasing interest thanks to their optoelectronic properties, comparable to lead-based materials, and their more eco-friendly nature. Among all the lead-free perovskite alternatives, this mini-review considers bismuth-based perovskites and perovskite derivatives with a specific focus on solar-driven photocatalysis application for H2 evolution. Special attention is dedicated to the structure and composition of the different materials and to the advantage of heterojunction engineering and the relative impact on the photocatalytic process. Full article
(This article belongs to the Special Issue Materials Chemistry in Italy)
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23 pages, 4101 KiB  
Review
A Critical Review of the Use of Bismuth Halide Perovskites for CO2 Photoreduction: Stability Challenges and Strategies Implemented
by Edith Luévano-Hipólito, Oscar L. Quintero-Lizárraga and Leticia M. Torres-Martínez
Catalysts 2022, 12(11), 1410; https://doi.org/10.3390/catal12111410 - 11 Nov 2022
Cited by 17 | Viewed by 4519
Abstract
Inspired by natural photosynthesis, the photocatalytic CO2 reduction reaction (CO2RR) stands as a viable strategy for the production of solar fuels to mitigate the high dependence on highly polluting fossil fuels, as well as to decrease the CO2 concentration in the [...] Read more.
Inspired by natural photosynthesis, the photocatalytic CO2 reduction reaction (CO2RR) stands as a viable strategy for the production of solar fuels to mitigate the high dependence on highly polluting fossil fuels, as well as to decrease the CO2 concentration in the atmosphere. The design of photocatalytic materials is crucial to ensure high efficiency of the CO2RR process. So far, perovskite materials have shown high efficiency and selectivity in CO2RR to generate different solar fuels. Particularly, bismuth halide perovskites have gained much attention due to their higher absorption coefficients, their more efficient charge transfer (compared to oxide perovskites), and their required thermodynamic potential for CO2RR. Moreover, these materials represent a promising alternative to the highly polluting lead halide perovskites. However, despite all the remarkable advantages of bismuth halide perovskites, their use has been limited, owing to instability concerns. As a consequence, recent reports have offered solutions to obtain structures highly stable against oxygen, water, and light, promoting the formation of solar fuels with promising efficiency for CO2RR. Thus, this review analyzes the current state of the art in this field, particularly studies about stability strategies from intrinsic and extrinsic standpoints. Lastly, we discuss the challenges and opportunities in designing stable bismuth halide perovskites, which open new opportunities for scaling up the CO2RR. Full article
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11 pages, 1815 KiB  
Article
Fast Lead-Free Humidity Sensor Based on Hybrid Halide Perovskite
by Veljko Djokić, Pavao Andričević, Márton Kollár, Anastasiia Ciers, Alla Arakcheeva, Milica Vasiljević, Dragan Damjanović, László Forró, Endre Horváth and Trpimir Ivšić
Crystals 2022, 12(4), 547; https://doi.org/10.3390/cryst12040547 - 14 Apr 2022
Cited by 5 | Viewed by 3529
Abstract
An environmentally friendly analog of the prominent methylammonium lead halide perovskite, methylammonium bismuth bromide (MA3Bi2Br9), was prepared and investigated in the form of powder, single crystals and nanowires. Complete characterization via synchrotron X-ray diffraction data showed that [...] Read more.
An environmentally friendly analog of the prominent methylammonium lead halide perovskite, methylammonium bismuth bromide (MA3Bi2Br9), was prepared and investigated in the form of powder, single crystals and nanowires. Complete characterization via synchrotron X-ray diffraction data showed that the bulk crystal does not incorporate water into the structure. At the same time, water is absorbed on the surface of the crystal, and this modification leads to the changes in the resistivity of the material, thus making MA3Bi2Br9 an excellent candidate for use as a humidity sensor. The novel sensor was prepared from powder-pressed pellets with attached carbon electrodes and was characterized by being able to detect relative humidity over the full range (0.7–96% RH) at ambient temperature. Compared to commercial and literature values, the response and recovery times are very fast (down to 1.5 s/1.5 s). Full article
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8 pages, 2852 KiB  
Communication
Two-Step Synthesis of Bismuth-Based Hybrid Halide Perovskite Thin-Films
by Vanira Trifiletti, Sally Luong, Giorgio Tseberlidis, Stefania Riva, Eugenio S. S. Galindez, William P. Gillin, Simona Binetti and Oliver Fenwick
Materials 2021, 14(24), 7827; https://doi.org/10.3390/ma14247827 - 17 Dec 2021
Cited by 10 | Viewed by 3364
Abstract
Lead halide perovskites have been revolutionary in the last decade in many optoelectronic sectors. Their bismuth-based counterparts have been considered a good alternative thanks to their composition of earth-abundant elements, good chemical stability, and low toxicity. Moreover, their electronic structure is in a [...] Read more.
Lead halide perovskites have been revolutionary in the last decade in many optoelectronic sectors. Their bismuth-based counterparts have been considered a good alternative thanks to their composition of earth-abundant elements, good chemical stability, and low toxicity. Moreover, their electronic structure is in a quasi-zero-dimensional (0D) configuration, and they have recently been explored for use beyond optoelectronics. A significant limitation in applying thin-film technology is represented by the difficulty of synthesizing compact layers with easily scalable methods. Here, the engineering of a two-step synthesis in an air of methylammonium bismuth iodide compact thin films is reported. The critical steps of the process have been highlighted so that the procedure can be adapted to different substrates and application areas. Full article
(This article belongs to the Special Issue Thin Films for Energy Production and Storage)
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15 pages, 3546 KiB  
Article
Molecular and Supramolecular Structures of Triiodides and Polyiodobismuthates of Phenylenediammonium and Its N,N-dimethyl Derivative
by Tatiana A. Shestimerova, Nikita A. Golubev, Mikhail A. Bykov, Andrei V. Mironov, Sergey A. Fateev, Alexey B. Tarasov, Ivan Turkevych, Zheng Wei, Evgeny V. Dikarev and Andrei V. Shevelkov
Molecules 2021, 26(18), 5712; https://doi.org/10.3390/molecules26185712 - 21 Sep 2021
Cited by 12 | Viewed by 2698
Abstract
Despite remarkable progress in photoconversion efficiency, the toxicity of lead-based hybrid perovskites remains an important issue hindering their applications in consumer optoelectronic devices, such as solar cells, LED displays, and photodetectors. For that reason, lead-free metal halide complexes have attracted great attention as [...] Read more.
Despite remarkable progress in photoconversion efficiency, the toxicity of lead-based hybrid perovskites remains an important issue hindering their applications in consumer optoelectronic devices, such as solar cells, LED displays, and photodetectors. For that reason, lead-free metal halide complexes have attracted great attention as alternative optoelectronic materials. In this work, we demonstrate that reactions of two aromatic diamines with iodine in hydroiodic acid produced phenylenediammonium (PDA) and N,N-dimethyl-phenylenediammonium (DMPDA) triiodides, PDA(I3)2⋅2H2O and DMPDA(I3)I, respectively. If the source of bismuth was added, they were converted into previously reported PDA(BiI4)2⋅I2 and new (DMPDA)2(BiI6)(I3)⋅2H2O, having band gaps of 1.45 and 1.7 eV, respectively, which are in the optimal range for efficient solar light absorbers. All four compounds presented organic–inorganic hybrids, whose supramolecular structures were based on a variety of intermolecular forces, including (N)H⋅⋅⋅I and (N)H⋅⋅⋅O hydrogen bonds as well as I⋅⋅⋅I secondary and weak interactions. Details of their molecular and supramolecular structures are discussed based on single-crystal X-ray diffraction data, thermal analysis, and Raman and optical spectroscopy. Full article
(This article belongs to the Special Issue Inorganic Materials Chemistry)
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15 pages, 8409 KiB  
Review
Recent Progress in Fabrication of Antimony/Bismuth Chalcohalides for Lead-Free Solar Cell Applications
by Yong Chan Choi and Kang-Won Jung
Nanomaterials 2020, 10(11), 2284; https://doi.org/10.3390/nano10112284 - 18 Nov 2020
Cited by 34 | Viewed by 5531
Abstract
Despite their comparable performance to commercial solar systems, lead-based perovskite (Pb-perovskite) solar cells exhibit limitations including Pb toxicity and instability for industrial applications. To address these issues, two types of Pb-free materials have been proposed as alternatives to Pb-perovskite: perovskite-based and non-perovskite-based materials. [...] Read more.
Despite their comparable performance to commercial solar systems, lead-based perovskite (Pb-perovskite) solar cells exhibit limitations including Pb toxicity and instability for industrial applications. To address these issues, two types of Pb-free materials have been proposed as alternatives to Pb-perovskite: perovskite-based and non-perovskite-based materials. In this review, we summarize the recent progress on solar cells based on antimony/bismuth (Sb/Bi) chalcohalides, representing Sb/Bi non-perovskite semiconductors containing chalcogenides and halides. Two types of ternary and quaternary chalcohalides are described, with their classification predicated on the fabrication method. We also highlight their utility as interfacial layers for improving other solar cells. This review provides clues for improving the performances of devices and design of multifunctional solar systems. Full article
(This article belongs to the Special Issue Nanostructures for Solar Cells and Photovoltaics)
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